methyl 6-methyl-2-[2-(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 6-methyl-2-[2-(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-methyl-2-[[2-(8-methyl-2-oxo-4-phenyl-chromen-7-yl)oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-2-[[2-[(8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-2-[[2-(8-methyl-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(2-keto-8-methyl-4-phenyl-chromen-7-yl)oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C29H27NO6S MolecularWeight: 517.59278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=C(C4=C(C=C3)C(=CC(=O)O4)C5=CC=CC=C5)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=C(C4=C(C=C3)C(=CC(=O)O4)C5=CC=CC=C5)C

InChI

InChI=1S/C29H27NO6S/c1-16-9-10-20-23(13-16)37-28(26(20)29(33)34-3)30-24(31)15-35-22-12-11-19-21(18-7-5-4-6-8-18)14-25(32)36-27(19)17(22)2/h4-8,11-12,14,16H,9-10,13,15H2,1-3H3,(H,30,31)